| SpectraBase Compound ID | 5zQHayjnb5y |
|---|---|
| InChI | InChI=1S/C9H14O/c1-3-5-6-7-9-10-8-4-2/h3-7H,2,8-9H2,1H3/b5-3+,7-6+ |
| InChIKey | LQYHMZZAZYFBBO-TWTPFVCWSA-N |
| Mol Weight | 138.21 g/mol |
| Molecular Formula | C9H14O |
| Exact Mass | 138.104465 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HwIZC0xTfKo |
|---|---|
| Name | (2E,4E)-1-(Allyloxy)hexa-2,4-diene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.104465070 u |
| Formula | C9H14O |
| InChI | InChI=1S/C9H14O/c1-3-5-6-7-9-10-8-4-2/h3-7H,2,8-9H2,1H3/b5-3+,7-6+ |
| InChIKey | LQYHMZZAZYFBBO-TWTPFVCWSA-N |
| Molecular Weight | 138.210 g/mol |
| SMILES | C(C=C)OC\C=C\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.852315 |